SCHEMBL2332616

SCHEMBL2332616

C=CC(=O)OC(C)(OC)OCC

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.36
HPGD P15428 1/20 0.36
THRB P10828 2/20 0.34
ALDH1A1 P00352 5/20 0.32
TP53 P04637 3/20 0.32
HIF1A Q16665 3/20 0.32
CYP3A4 P08684 2/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1070261 0.90 TSHR (0.39) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL18166514 0.87 TSHR (0.37) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL7771137 0.82 TSHR (0.42) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL7941505 0.81 THRB (0.35) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL10592331 0.80 ALDH1A1 (0.43) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL28797570 0.79 THRB (0.39) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL1898814 0.79 TSHR (0.39) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL9748315 0.78 ALDH1A1 (0.35) ALDH1A1
SCHEMBL9578343 0.77 TSHR (0.38) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL27498018 0.77 TSHR (0.38) TSHRHPGDTHRBALDH1A1TP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1590417-B1 MODIFIED PRESSURE SENSITIVE ADHESIVE MOMENTIVE SPECIALTY CHEMICALS RES BELGIUM (BE) 2011-08-17 EP disclosed
EP-1351996-B1 GAMMA RADIATION POLYMERIZED EMULSION-BASED (METH)ACRYLATE PRESSURE SENSITIVE ADHESIVES AND METHODS OF MAKING AND USING SAME 3M INNOVATIVE PROPERTIES CO (US) 2006-03-08 EP disclosed
EP-1590417-A1 MODIFIED PRESSURE SENSITIVE ADHESIVE Resolution Specialty Materials LLC (US) 2005-11-02 EP disclosed
US-20050054778-A1 Reacting an ethenically unsaturated ester and acid, such as butyl acrylate and acrylic acid, to form a base polymer, then reacting with a poly(n-vinyl lactam); lactam rings may be opened for grafting; improved shear strength without a significant reduction in peel and tack HEXION INC. 2005-03-10 US disclosed
WO-2005014752-A1 MODIFIED PRESSURE SENSITIVE ADHESIVE RESOLUTION SPECIALTY MATERIALS LLC (US) 2005-02-17 WO disclosed
US-6825278-B2 AFTER COMPLETION OF ADDITION POLYMERIZATION, REACTING WITH N-VINYLLACTAM MODIFYING POLYER IN PRESENCE OF FREE RADICAL INITIATOR; TAPES, LABELS, STICKERS, DECALS, DECORATIVE VINYLS, LAMINATES, AND WALL COVERINGS RESOLUTION SPECIALTY MATERIALS LLC 2004-11-30 US disclosed
US-20040143065-A1 Modified pressure sensitive adhesive HEXION INC. (FORMERLY KNOWN AS MOMENTIVE SPECIALTY CHEMICALS INC.) 2004-07-22 US disclosed
EP-1351996-A1 GAMMA RADIATION POLYMERIZED EMULSION-BASED (METH)ACRYLATE PRESSURE SENSITIVE ADHESIVES AND METHODS OF MAKING AND USING SAME 3M Innovative Properties Company (US) 2003-10-15 EP disclosed
US-6461728-B2 OBTAINED BY POLYMERIZATION OF AN AQUEOUS EMULSION OF A (METH)ACRYLATE MONOMER, A POLAR, FREE-RADICALLY POLYMERIZABLE MATERIAL SUCH AS ACRYLIC ACID AND EMULSIFIER 3M INNOVATIVE PROPERTIES COMPANY 2002-10-08 US disclosed
US-20020136890-A1 Gamma radiation polymerized emulsion-based (meth)acrylate pressure sensitive adhesives and methods of making and using same APPLIED SCIENCE FICTION, INC. 2002-09-26 US disclosed
WO-2002053602-A1 GAMMA RADIATION POLYMERIZED EMULSION-BASED (METH)ACRYLATE PRESSURE SENSITIVE ADHESIVES AND METHODS OF MAKING AND USING SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-07-11 WO disclosed